SpectraBase Spectrum ID |
4RFhWgtU2qZ |
Name |
2-[2-Chloro-7-(methylsulfonyl)quinolin-3-yl]-2-methylpropan-1-ol |
Appearance |
Colorless solid |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H16ClNO3S |
InChI |
InChI=1S/C14H16ClNO3S/c1-14(2,8-17)11-6-9-4-5-10(20(3,18)19)7-12(9)16-13(11)15/h4-7,17H,8H2,1-3H3 |
InChIKey |
ZLYNKMDKQCGPQJ-UHFFFAOYSA-N |
Instrument Name |
HP 6890 Series |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/anie.201814193 |
Molecular Weight |
313.799 g/mol |
Reported Formula |
C14H16ClNO3S |
SMILES |
OCC(c1c(Cl)nc2cc(ccc2c1)S(C)(=O)=O)(C)C |
SPLASH |
splash10-001i-0930000000-e34649f1a3b5a8d8f0ed |
Source of Spectrum |
ACI-58-SM22-S16 |
Thin-Layer Chromatography |
Rf = 0.53 (EtOAc) |
Wiley ID |
1843116 |